SCHEMBL26464783

SCHEMBL26464783

CC(C)(C)NC(=O)CN1C2CC1CN(CC(=O)Nc1cc(F)c(F)c(Cl)c1)C2

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 15/20 0.46
HPGD P15428 1/20 0.40
CYP2D6 P10635 1/20 0.40
KCNH2 Q12809 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
CACNA1G O43497 1/20 0.38
CACNA1I Q9P0X4 1/20 0.38
KMT2A Q03164 1/20 0.37
HTT P42858 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26465699 0.88 HPGD (0.55) CACNA1HHPGDCYP2D6L3MBTL1KMT2A
SCHEMBL26466921 0.87 CACNA1H (0.41) CACNA1HHPGDCYP2D6KCNH2L3MBTL1
SCHEMBL26465838 0.85 CACNA1H (0.55) CACNA1HCYP2D6KCNH2CACNA1GCACNA1I
SCHEMBL26464490 0.85 CACNA1H (0.54) CACNA1HCYP2D6KCNH2CACNA1GCACNA1I
SCHEMBL26466097 0.83 CACNA1H (0.45) CACNA1HHPGDCYP2D6L3MBTL1KMT2A
SCHEMBL26465689 0.82 CACNA1H (0.54) CACNA1HCACNA1GCACNA1IKMT2A
SCHEMBL26464503 0.81 KCNT1 (0.49) CACNA1HCACNA1GCACNA1IKMT2A
SCHEMBL26464500 0.80 CACNA1H (0.70) CACNA1HKMT2AHTT
SCHEMBL26465833 0.79 CACNA1H (0.56) CACNA1HCYP2D6KCNH2CACNA1IKMT2A
SCHEMBL26463608 0.79 CACNA1H (0.56) CACNA1HCYP2D6KCNH2CACNA1GCACNA1I

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192669-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING A PIPERAZINE OR 1,4-DIAZEPANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2023-10-05 WO disclosed